ethyl (2S,3R)-2,4-dimethyl-3-(phenylmethyl)pent-4-enoate

Systemtic Name: ethyl (2S,3R)-2,4-dimethyl-3-(phenylmethyl)pent-4-enoate Openeye Name: ethyl (2S,3R)-3-benzyl-2,4-dimethyl-pent-4-enoate CAS Name: (2S,3R)-2,4-dimethyl-3-(phenylmethyl)-4-pentenoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3-benzyl-2,4-dimethylpent-4-enoate Traditional Name: (2S,3R)-3-benzyl-2,4-dimethyl-pent-4-enoic acid ethyl ester Formula: C16H22O2 MolecularWeight: 246.34468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C(CC1=CC=CC=C1)C(=C)C

Isomeric SMILES

CCOC(=O)[C@@H](C)[C@@H](CC1=CC=CC=C1)C(=C)C

InChI

InChI=1S/C16H22O2/c1-5-18-16(17)13(4)15(12(2)3)11-14-9-7-6-8-10-14/h6-10,13,15H,2,5,11H2,1,3-4H3/t13-,15-/m0/s1